10967/234 - QDB Compounds

QsarDB Repository

Garcia-Sosa, A. T.; Maran, U. Using combined docking, chemical fingerprints, and Bayesian classifiers for the androgen receptor binding activity of the CoMPARA data. Toxicological Sciences 2020.

Compound

ID:598-91-4
Name:Dibromonitromethane
Description:
Labels:eval
CAS:598-91-4
InChi Code:InChI=1S/CHBr2NO2/c2-1(3)4(5)6/h1H

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.006549811

Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class)